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3-Vinylpyridine

CAT: 0127-OR8894-01Size: 1 gDry Ice: NoHazardous: No
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CAS Number
1121-55-7
Synonyms
3-Ethenylpyridine
MDL Number
MFCD02178019
Purity
=95%
Smiles
C=Cc1cccnc1
Additionnal Information
Stabilised with 4-tert-butylcatechol
Storage Conditions
Store at 2-8°C

Chemical Information

3-Vinylpyridine

3-vinylpyridine has been reported in Nicotiana tabacum and Arctostaphylos uva-ursi with data available.

CAS Number1121-55-7
PubChem CID14272
IUPAC Name3-ethenylpyridine
Molecular FormulaC7H7N
Molecular Weight105.14
XLogP1.4
Topological Polar Surface Area12.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count8
Formal Charge0
Complexity78
SMILES
C=CC1=CN=CC=C1
InChI
InChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2
InChIKey
DPZYLEIWHTWHCU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Vinylpyridine
CAS: 1121-55-7
CID: 14272
Formula: C7H7N
MW: 105.14
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight105.14
XLogP31.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass105.057849228
Monoisotopic Mass105.057849228
Topological Polar Surface Area12.9 Ų
Heavy Atom Count8
Formal Charge0
Complexity78.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes